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78324-75-1 | 3,4,5-Trifluorobenzamide
CAS No: 78324-75-1 Catalog No: AG003IEL MDL No:MFCD00083524
Product Description
Catalog Number:
AG003IEL
Chemical Name:
3,4,5-Trifluorobenzamide
CAS Number:
78324-75-1
Molecular Formula:
C7H4F3NO
Molecular Weight:
175.1080
MDL Number:
MFCD00083524
IUPAC Name:
3,4,5-trifluorobenzamide
InChI:
InChI=1S/C7H4F3NO/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2H,(H2,11,12)
InChI Key:
NCMVOBYFZPFCOH-UHFFFAOYSA-N
SMILES:
NC(=O)c1cc(F)c(c(c1)F)F
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.024g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.11g/mol
Monoisotopic Mass:
175.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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